Basic information
- CAS
58470-78-3- Standard SMILES
O=C1NC(=O)C(c2ccco2)=C1Cl- InChIKey
RHEPEQHIDVKTAP-UHFFFAOYSA-N- Molecular formula
- C8H4ClNO3
- Average molar mass
- 197.57 g/mol
- Monoisotopic mass
- 196.9879707
Names & identifiers
- Preferred name
- 3-Chloro-4-(furan-2-yl)-1H-pyrrole-2,5-dione
- IUPAC
- 3-chloro-4-(furan-2-yl)pyrrole-2,5-dione
Names & synonyms
58470-78-33-Chloro-4-(furan-2-yl)-1H-pyrrole-2,5-dioneDTXSID40849718
Database identifiers
- CAS
58470-78-3- PubChem CID
- 71440751
- DTXSID
DTXSID40849718
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 59.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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